Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 3 results

Search term: XKQLUUAHCWUFFQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8495720

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C22H34O8/c1-11-6-7-14(24)21(5)15(25)8-9-20(4,27)17(21)18(29-13(3)23)22(28)12(2)19(26)30-16(22)10-11/h10,12,14-18,24-25,27-28H,6-9H2,1-5H3/b11-10-/t12-,14-,15-,16-,17-,18-,20-,21-,22-/m0/s1
C22H34O8426.50064300
10478309

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C22H34O8/c1-11-6-7-14(24)21(5)15(25)8-9-20(4,27)17(21)18(29-13(3)23)22(28)12(2)19(26)30-16(22)10-11/h10,12,14-18,24-25,27-28H,6-9H2,1-5H3/b11-10-/t12-,14+,15-,16-,17-,18+,20-,21-,22-/m0/s1
C22H34O8426.50064400
8773884

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C22H34O8/c1-11-6-7-14(24)21(5)15(25)8-9-20(4,27)17(21)18(29-13(3)23)22(28)12(2)19(26)30-16(22)10-11/h10,12,14-18,24-25,27-28H,6-9H2,1-5H3/b11-10-/t12-,14-,15-,16-,17-,18+,20-,21-,22-/m0/s1
C22H34O8426.50062100

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